ethyl 4-(4-bromophenyl)-2-[(4-butylcyclohexyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-bromophenyl)-2-[(4-butylcyclohexyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-bromophenyl)-2-[(4-butylcyclohexanecarbonyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-bromophenyl)-2-[[(4-butylcyclohexyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-bromophenyl)-2-[(4-butylcyclohexanecarbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-bromophenyl)-2-[(4-butylcyclohexanecarbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C24H30BrNO3S MolecularWeight: 492.4689

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Br)C(=O)OCC

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)Br)C(=O)OCC

InChI

InChI=1S/C24H30BrNO3S/c1-3-5-6-16-7-9-18(10-8-16)22(27)26-23-21(24(28)29-4-2)20(15-30-23)17-11-13-19(25)14-12-17/h11-16,18H,3-10H2,1-2H3,(H,26,27)